DL-4-Chlorophenylalanine ethyl ester hydrochloride(52031-05-7) IR1
Product NameDL-4-Chlorophenylalanine ethyl ester hydrochloride
CAS52031-05-7
Molecular FormulaC11H15Cl2NO2
Molecular Weight264.15
InChIInChI=1S/C11H14ClNO2.ClH/c1-2-15-11(14)10(13)7-8-3-5-9(12)6-4-8;/h3-6,10H,2,7,13H2,1H3;1H
InChIKey FDQIKGOQYNZYOO-UHFFFAOYSA-N
SmilesC1(=CC=C(Cl)C=C1)CC(N)C(=O)OCC.Cl
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MassMS-NW-7428 4-chloro-DL-phenylalanine ethyl ester hydrochloride C11H14ClNO2 HCl (Mass of molecular ion: 227)
Source Temperature: 150 °C Sample Temperature: 130 °C Direct, 75 eV
18.0 2.4 27.0 2.4 28.0 11.9 29.0 6.3 30.0 1.3 35.0 2.0 36.0 12.9 38.0 4.4 39.0 2.5 42.0 3.2 43.0 3.1 46.0 5.7 47.0 1.5 50.0 1.5 51.0 2.0 58.5 3.3 59.0 1.6 59.5 4.2 63.0 3.1 65.0 2.3 74.0 38.5 75.0 2.8 77.0 3.3 78.0 1.0 89.0 5.1 90.0 2.3 91.0 8.9 92.0 1.2 99.0 1.6 101.0 2.0 102.0 100.0 103.0 5.4 104.0 1.0 117.0 2.4 118.0 6.6 119.0 12.3 120.0 1.1 125.0 7.1 126.0 1.7 127.0 2.5 153.0 2.1 154.0 40.5 155.0 4.4 156.0 13.6 157.0 1.3 227.0 1.4
D2O
KBr disc
nujol mull
